Theoretical study of the adsorption of aromatic units on carbon allotropes including explicit (empirical) DFT dispersion corrections and implicitly dispersion-corrected functionals: The pyridine case

  1. Ramos-Berdullas, N.
  2. Pérez-Juste, I.
  3. Van Alsenoy, C.
  4. Mandado, M.
Aldizkaria:
Physical Chemistry Chemical Physics

ISSN: 1463-9076

Argitalpen urtea: 2015

Alea: 17

Zenbakia: 1

Orrialdeak: 575-587

Mota: Artikulua

DOI: 10.1039/C4CP02341B GOOGLE SCHOLAR